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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02367291

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CSAS-ACETONYLCYSTEINEA,B1DWQ0.74
BUCS,S-BUTYLTHIOCYSTEINEA1A2U0.75
CMTO-METHYLCYSTEINEG1OMW0.82
CMTO-METHYLCYSTEINEA,G3CIK0.82
CMTO-METHYLCYSTEINEA1DOA0.82
ESC2-AMINO-4-ETHYL SULFANYL BUTYRIC ACIDH,P1KBG0.74
CS0S-(2-HYDROXYETHYL)-L-CYSTEINEA1ASV0.77
ML32-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-
N,N,N-trimethylethanaminium
F3C1B0.72
MT2[(3S)-3-amino-3-carboxypropyl](ethyl)methylsulfoniumA3C8F0.76
CMHS-(METHYLMERCURY)-L-CYSTEINEA,B,C,D1WB20.73
CMHS-(METHYLMERCURY)-L-CYSTEINEA2FOU0.73
CMHS-(METHYLMERCURY)-L-CYSTEINEA2FOS0.73
CMHS-(METHYLMERCURY)-L-CYSTEINEA2NNS0.73
CMHS-(METHYLMERCURY)-L-CYSTEINEA2FOV0.73
CMHS-(METHYLMERCURY)-L-CYSTEINEA,B,C,D1WB30.73
CMHS-(METHYLMERCURY)-L-CYSTEINEA,B,C,D1WB10.73
CMHS-(METHYLMERCURY)-L-CYSTEINEA2NNG0.73
CMHS-(METHYLMERCURY)-L-CYSTEINEA2NNO0.73
CMHS-(METHYLMERCURY)-L-CYSTEINEA2NNV0.73
CMHS-(METHYLMERCURY)-L-CYSTEINEA2FOQ0.73
M0HS-(HYDROXYMETHYL)-L-CYSTEINEA2PFG0.77
MHOS-OXYMETHIONINEA,B2A9E0.71
MHOS-OXYMETHIONINEA1ST20.71
MHOS-OXYMETHIONINEA1NLR0.71
MHOS-OXYMETHIONINEA2IDU0.71
MHOS-OXYMETHIONINEA3D940.71
MHOS-OXYMETHIONINEA1EK00.71
MHOS-OXYMETHIONINEA1UP20.71
MHOS-OXYMETHIONINEA1XJO0.71
MHOS-OXYMETHIONINEA,E2IUF0.71
MHOS-OXYMETHIONINEA1SF50.71
MHOS-OXYMETHIONINEA1UP00.71
MHOS-OXYMETHIONINEA9PTI0.71
MHOS-OXYMETHIONINEA2IDT0.71
MHOS-OXYMETHIONINEA2QDV0.71
MHOS-OXYMETHIONINEA2QDW0.71
MHOS-OXYMETHIONINEA,B1F4G0.71
MHOS-OXYMETHIONINEA,B2IQF0.71
CAFS-DIMETHYLARSINOYL-CYSTEINEA,B2DYB0.73
CAFS-DIMETHYLARSINOYL-CYSTEINEA1HYV0.73
CAFS-DIMETHYLARSINOYL-CYSTEINEA,B,C,D2C7V0.73
CAFS-DIMETHYLARSINOYL-CYSTEINEA1SNG0.73
CAFS-DIMETHYLARSINOYL-CYSTEINEA2IWR0.73
CAFS-DIMETHYLARSINOYL-CYSTEINEA2FAU0.73
CAFS-DIMETHYLARSINOYL-CYSTEINEA1HYZ0.73
CAFS-DIMETHYLARSINOYL-CYSTEINEA3F7D0.73
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1HW40.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D,E,F2C5Q0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEI,J,K,L,M,N,
O,P
1JZ10.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,D2C4O0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GEV0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1HQS0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2G5O0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2G4L0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,G,H3CFA0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D1PZG0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2B1V0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1Q9U0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1QQQ0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XM40.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1WDR0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2EF80.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XMY0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEI,J,K,L,M,N,
O,P
1JYZ0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA3EWY0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1PME0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D1Y8Z0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1YI40.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA3EWX0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2VB00.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2FAI0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D1QVV0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA3FS50.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1XOS0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GES0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XMU0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1J3H0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,D2CLW0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEB,D,F,H,J,L1YKO0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1ELJ0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEE1R8M0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,G,H3CFF0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XOT0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1EUD0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1EVF0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2OQX0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1Y2J0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA3C7Q0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1QVW0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,C,D1K2X0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1ZKY0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2A2J0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1EV80.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1WZ90.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1YHS0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GA80.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GAA0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2P3B0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,I1ZPK0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2B1Z0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1A1V0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1A2T0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1Y2H0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1YPV0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D,E,F,
G,H
1JYY0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,I1Z8C0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2QXS0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B3ET00.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2P3A0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1KSH0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,G,H3CFH0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2V1P0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1OCS0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2G440.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2J830.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1EV50.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1L6Y0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2V0Y0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2Q590.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1JVY0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2P3C0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2AQ50.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,E1S9D0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1JEO0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2CZL0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2OCF0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1YI30.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D,E,F,
Y,Z
2OX50.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1EVG0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2RD80.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2B230.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C1HQG0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2CFA0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEI,J,K,L,M,N,
O,P
1GHO0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XLX0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEB,D,F,H,J,L1YKK0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1HW30.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D1JN90.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,D,F,H,J,L1YKP0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XLZ0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1TAZ0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GET0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2QA80.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2QZO0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1XV50.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D,E,F,
G,H
1JZ00.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XN00.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1UPI0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEB,D,F,H,J,L1YKM0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XM60.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEB,D,F,H,J,L1YKN0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2ONB0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1TLV0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D1HVY0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B3D6I0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1OCU0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,I1ZBG0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GEU0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2HAI0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1EUC0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D,E,F,
G,H
1F490.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1L6S0.75
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1KSJ0.75
MEDD-METHIONINEA1Y9Q0.75
MEDD-METHIONINEA,B2Q330.75
MEDD-METHIONINEA1ZUE0.75
MEDD-METHIONINEA1KQ00.75
MEDD-METHIONINEA,B3GP40.75
MEDD-METHIONINEA1TKJ0.75
MSL(2S)-2-AMINO-4-(METHYLSULFONIMIDOYL)BUTANOIC ACIDA,B2J8R0.7
MSL(2S)-2-AMINO-4-(METHYLSULFONIMIDOYL)BUTANOIC ACIDA,B,C,D,E,F,
G,H,I,J
2D3B0.7
CCSCARBOXYMETHYLATED CYSTEINEE1STF0.74
CCSCARBOXYMETHYLATED CYSTEINEA,B,C,D,E,F1GTI0.74
CCSCARBOXYMETHYLATED CYSTEINEA,B2BJ40.74
CCSCARBOXYMETHYLATED CYSTEINEA,B2JFA0.74
CCSCARBOXYMETHYLATED CYSTEINEG,R1DSS0.74
CCSCARBOXYMETHYLATED CYSTEINEA,B1L2I0.74
CCSCARBOXYMETHYLATED CYSTEINEA,B,C,D3DMT0.74
CCSCARBOXYMETHYLATED CYSTEINEA,B1ERR0.74
CCSCARBOXYMETHYLATED CYSTEINEA2JX40.74
GT9S-NONYL-CYSTEINEA,B,C,D12GS0.72
CY4S-BUTYRYL-CYSTEINA,B,C,D1M4T0.75
M2L(2R)-2-amino-3-(2-dimethylaminoethylsulfanyl)propanoic acidA2K3Y0.73
M2L(2R)-2-amino-3-(2-dimethylaminoethylsulfanyl)propanoic acidA,E3C1C0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA,B3G2F0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA,B1FU10.73
CASS-(DIMETHYLARSENIC)CYSTEINEA2IM20.73
CASS-(DIMETHYLARSENIC)CYSTEINEA,B2CJW0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA,B2JBH0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA1JQ60.73
CASS-(DIMETHYLARSENIC)CYSTEINEB2HZE0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA2IM30.73
CASS-(DIMETHYLARSENIC)CYSTEINEA2H790.73
CASS-(DIMETHYLARSENIC)CYSTEINEA2ILZ0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA2IM10.73
CASS-(DIMETHYLARSENIC)CYSTEINEA1RA60.73
CASS-(DIMETHYLARSENIC)CYSTEINEA1TQL0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA2RA80.73
CASS-(DIMETHYLARSENIC)CYSTEINEA,B1I830.73
CASS-(DIMETHYLARSENIC)CYSTEINEA,B3E7S0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA,B1ZZS0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA2ILY0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA2IM00.73
CASS-(DIMETHYLARSENIC)CYSTEINEX3GWS0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA,B2W9J0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA,B1ZZT0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA2H770.73
CASS-(DIMETHYLARSENIC)CYSTEINEA1FYX0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA,B2HMH0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA1BHL0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA,B,C1FF30.73
CASS-(DIMETHYLARSENIC)CYSTEINEA1R4X0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA1S6C0.73
CASS-(DIMETHYLARSENIC)CYSTEINEA1RA70.73
CASS-(DIMETHYLARSENIC)CYSTEINEA,B3ET60.73
CASS-(DIMETHYLARSENIC)CYSTEINEA1FYW0.73